MassBank Record: JP001775



 EICOSANOIC ACID BUTYL ESTER; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP001775
RECORD_TITLE: EICOSANOIC ACID BUTYL ESTER; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: EICOSANOIC ACID BUTYL ESTER CH$COMPOUND_CLASS: N/A CH$FORMULA: C24H48O2 CH$EXACT_MASS: 368.36543 CH$SMILES: CCCCCCCCCCCCCCCCCCCC(=O)OCCCC CH$IUPAC: InChI=1S/C24H48O2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24(25)26-23-6-4-2/h3-23H2,1-2H3
AC$INSTRUMENT: Unknown AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0a4i-9312000000-5c18561353183b7e2035 PK$NUM_PEAK: 91 PK$PEAK: m/z int. rel.int. 41 1.1 11 43 1.83 18 55 1.12 11 56 99.99 999 57 19.23 192 58 0.52 5 60 11.48 115 61 15.89 159 69 1.51 15 70 0.96 10 71 7.23 72 73 19.2 192 74 1.52 15 81 0.7 7 82 0.8 8 83 3.44 34 84 3.38 34 85 5.49 55 86 0.6 6 87 3.09 31 88 0.3 3 95 0.92 9 96 0.88 9 97 4.42 44 98 3.85 39 99 2.25 23 101 6.27 63 102 0.7 7 109 0.92 9 110 0.4 4 111 3.16 32 112 0.99 10 113 1.34 13 115 2.79 28 116 18.61 186 117 12.77 128 118 0.6 6 123 0.27 3 125 1.7 17 126 0.37 4 127 0.89 9 129 19.49 195 130 1.82 18 135 0.22 2 139 1.1 11 141 0.57 6 142 0.21 2 143 1.77 18 153 0.64 6 155 0.41 4 157 1.4 14 158 0.69 7 167 0.41 4 171 2.88 29 172 0.81 8 181 0.22 2 185 5.81 58 186 0.73 7 195 0.21 2 199 0.79 8 208 0.12 1 209 0.23 2 213 1.84 18 214 0.3 3 227 1.67 17 228 0.28 3 241 1.35 14 250 0.25 3 255 0.67 7 265 0.23 2 269 3.56 36 270 0.93 9 283 1.03 10 284 0.3 3 292 0.37 4 293 0.78 8 294 0.27 3 295 10.02 100 296 2.08 21 297 0.29 3 311 0.64 6 312 11.25 113 313 25 250 314 5.33 53 315 0.53 5 325 1.37 14 326 0.19 2 367 0.16 2 368 13.94 139 369 3.83 38 370 0.54 5 //